CID 14225662

26119-44-8

Structural Information

Molecular Formula

C₆H₁₀O

SMILES

CC1(CC1C=O)C

InChI

InChI=1S/C6H10O/c1-6(2)3-5(6)4-7/h4-5H,3H2,1-2H3

InChIKey

PQTDYOQEPYGGHF-UHFFFAOYSA-N

Compound name

2,2-dimethylcyclopropane-1-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 98
Patents: 98.073166 Da
Monoisotopic Mass: 1.0
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]+	99.080442	120.2
[M+Na]+	121.06238	133.5
[M+NH4]+	116.10699	131.2
[M+K]+	137.03632	127.4
[M-H]-	97.065890	128.6
[M+Na-2H]-	119.04783	130.0
[M]+	98.072617	125.7
[M]-	98.073715	125.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe