2,6,6-trimethyl-bicyclo[3.1.1]heptane-3-carboxaldehyde

2,6,6-Trimethylbicyclo[3.1.1]heptane-3-carbaldehyde
2,6,6-Trimethylbicyclo[3.1.1]heptane-3-carboxaldehyde
Bicyclo[3.1.1]heptane-3-carboxaldehyde, 2,6,6-trimethyl-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	VUNCLQCPKWLBRY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C11H18O/c1-7-8(6-12)4-9-5-10(7)11(9,2)3/h6-10H,4-5H2,1-3H3
IUPAC name chemrof:IUPAC_name	2,6,6-trimethyl-bicyclo[3.1.1]heptane-3-carboxaldehyde
Molecular formula chemrof:molecular_formula	C11H18O
Molecular mass chemrof:molecular_mass	166.264
Monoisotopic mass chemrof:monoisotopic_mass	166.135765
SMILES string chemrof:smiles_string	CC1C(C=O)CC2CC1C2(C)C

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=60113-43-1	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.056.402	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID10866790	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J298.780E	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/108415	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q82854762	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
1f6c0093-51ec-4c40-b995-4222a0a1136b	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
266f473d-c943-4779-b11f-6c34b9e9aabd	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
82b172de-c403-4d21-a3a1-cc26b1da73d5	Environmental → Air → Indoor	EF 3.1	kg	2
acee5ff9-c012-484e-b497-2c9ae6893658	Environmental → Air → Long-term	EF 3.1	kg	0
08c3ad73-6d2b-449d-bc11-ea1eee1885fe	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
9f055c2c-58f1-4ee7-8cd1-27b55d4d22ac	Environmental → Air → Unknown	EF 3.1	kg	2
45c47a2a-aae1-4494-8959-f0abdfc64c43	Environmental → Ground → Agricultural	EF 3.1	kg	2
2caa6902-76db-4e24-97ae-dbb5c4f40df8	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
6cbaf08f-4a29-4053-bf10-8981369f7fcd	Environmental → Ground → Unknown	EF 3.1	kg	2
d326b4cc-bfa9-4c58-8dda-0217b79d4acd	Environmental → Water → Long-term	EF 3.1	kg	0
b0b7e2ce-32ec-4acb-949c-5a979bdbf93e	Environmental → Water → Ocean	EF 3.1	kg	2
4df478f0-ab04-457c-b1cf-07309d740781	Environmental → Water → Surface water	EF 3.1	kg	2
61f4718e-a99a-41e4-875b-f24fac912237	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (53 changes)

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Flow object JSON

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2,6,6-trimethyl-bicyclo[3.1.1]heptane-3-carboxaldehyde

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

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