CID 23000221

4-cyclopropylbutan-1-ol

Structural Information

Molecular Formula

C₇H₁₄O

SMILES

C1CC1CCCCO

InChI

InChI=1S/C7H14O/c8-6-2-1-3-7-4-5-7/h7-8H,1-6H2

InChIKey

ZBSZQTUXBJZOLE-UHFFFAOYSA-N

Compound name

4-cyclopropylbutan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 182
Patents: 114.10446 Da
Monoisotopic Mass: 1.9
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]+	115.11174	123.7
[M+Na]+	137.09368	135.6
[M+NH4]+	132.13828	133.0
[M+K]+	153.06762	131.1
[M-H]-	113.09718	131.5
[M+Na-2H]-	135.07913	131.5
[M]+	114.10391	128.6
[M]-	114.10501	128.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe