CID 9581335

Octanal, 3,7-dimethyl-, oxime

Structural Information

Molecular Formula

C₁₀H₂₁NO

SMILES

CC(C)CCCC(C)C/C=N/O

InChI

InChI=1S/C10H21NO/c1-9(2)5-4-6-10(3)7-8-11-12/h8-10,12H,4-7H2,1-3H3/b11-8+

InChIKey

NFWQKRXFFKMVKP-DHZHZOJOSA-N

Compound name

(NE)-N-(3,7-dimethyloctylidene)hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 171.16231 Da
Monoisotopic Mass: 3.7
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]+	172.16959	143.1
[M+Na]+	194.15153	151.5
[M+NH4]+	189.19613	150.3
[M+K]+	210.12547	146.0
[M-H]-	170.15503	142.7
[M+Na-2H]-	192.13698	145.6
[M]+	171.16176	143.8
[M]-	171.16286	143.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe