CID 9855536

P-mentha-3-en-7-ol

Structural Information

Molecular Formula

C₁₀H₁₈O

SMILES

CC(C)C1=CCC(CC1)CO

InChI

InChI=1S/C10H18O/c1-8(2)10-5-3-9(7-11)4-6-10/h5,8-9,11H,3-4,6-7H2,1-2H3

InChIKey

CQRYMYGKLOLNOV-UHFFFAOYSA-N

Compound name

(4-propan-2-ylcyclohex-3-en-1-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 4
Patents: 154.13577 Da
Monoisotopic Mass: 2.0
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]+	155.14305	135.9
[M+Na]+	177.12499	141.0
[M-H]-	153.12849	137.6
[M+NH4]+	172.16959	156.4
[M+K]+	193.09893	139.5
[M+H-H2O]+	137.13303	130.8
[M+HCOO]-	199.13397	154.9
[M+CH3COO]-	213.14962	176.4
[M+Na-2H]-	175.11044	139.1
[M]+	154.13522	132.6
[M]-	154.13632	132.6

Literature stripe

literature stripe

Patent stripe

patents stripe