CID 14435658

1-(propan-2-yl)cyclopropan-1-ol

Structural Information

Molecular Formula

C₆H₁₂O

SMILES

CC(C)C1(CC1)O

InChI

InChI=1S/C6H12O/c1-5(2)6(7)3-4-6/h5,7H,3-4H2,1-2H3

InChIKey

HWUUJXHUDBJPRY-UHFFFAOYSA-N

Compound name

1-propan-2-ylcyclopropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 143
Patents: 100.08881 Da
Monoisotopic Mass: 1.2
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	122.1
[M+Na]+	123.07803	134.2
[M+NH4]+	118.12263	132.9
[M+K]+	139.05197	128.9
[M-H]-	99.081534	130.0
[M+Na-2H]-	121.06348	131.2
[M]+	100.08826	127.2
[M]-	100.08936	127.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe