CID 20426485

3-cyclopropylpropan-1-ol

Structural Information

Molecular Formula

C₆H₁₂O

SMILES

C1CC1CCCO

InChI

InChI=1S/C6H12O/c7-5-1-2-6-3-4-6/h6-7H,1-5H2

InChIKey

ISBNDFWSSCIEHO-UHFFFAOYSA-N

Compound name

3-cyclopropylpropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 568
Patents: 100.08881 Da
Monoisotopic Mass: 1.4
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]+	101.09609	119.9
[M+Na]+	123.07803	131.9
[M+NH4]+	118.12263	129.3
[M+K]+	139.05197	127.6
[M-H]-	99.081534	127.7
[M+Na-2H]-	121.06348	127.9
[M]+	100.08826	124.8
[M]-	100.08936	124.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe