CID 9570722

Usaf cs-503

Structural Information

Molecular Formula
C9H18N2O2
SMILES
CCC(/C(=N/O)/CC)/C(=N/O)/CC
InChI
InChI=1S/C9H18N2O2/c1-4-7(8(5-2)10-12)9(6-3)11-13/h7,12-13H,4-6H2,1-3H3/b10-8+,11-9+
InChIKey
PDXXYPZTPKWGIJ-GFULKKFKSA-N
Compound name
(NE)-N-[(5E)-4-ethyl-5-hydroxyiminoheptan-3-ylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.13683 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.14411 145.9
[M+Na]+ 209.12605 150.2
[M-H]- 185.12955 145.9
[M+NH4]+ 204.17065 165.0
[M+K]+ 225.09999 150.3
[M+H-H2O]+ 169.13409 140.0
[M+HCOO]- 231.13503 168.7
[M+CH3COO]- 245.15068 189.4
[M+Na-2H]- 207.11150 147.9
[M]+ 186.13628 146.0
[M]- 186.13738 146.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.