CID 110989

1h-indene, 3a,4,7,7a-tetrahydro-4-methyl-

Structural Information

Molecular Formula

C₁₀H₁₄

SMILES

CC1C=CCC2C1C=CC2

InChI

InChI=1S/C10H14/c1-8-4-2-5-9-6-3-7-10(8)9/h2-4,7-10H,5-6H2,1H3

InChIKey

YVLGRGCYQOZGCO-UHFFFAOYSA-N

Compound name

4-methyl-3a,4,7,7a-tetrahydro-1H-indene

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 27
Patents: 134.10954 Da
Monoisotopic Mass: 2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	135.11682	128.0
[M+Na]+	157.09876	140.4
[M+NH4]+	152.14336	139.1
[M+K]+	173.07270	134.4
[M-H]-	133.10226	131.5
[M+Na-2H]-	155.08421	134.2
[M]+	134.10899	130.8
[M]-	134.11009	130.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe